UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

7151226
7151226
23816926
23816926
23816930
23816930

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Popular Name: N-ethyl-2-[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanyl-propanamide N-ethyl-2-[1-(4-hydroxyphenyl)te…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.88 -1.65 -10.82 2 7 0 92 293.352 5 ↓

Analogs

23816926
23816926
23816930
23816930
7151225
7151225

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Popular Name: N-ethyl-2-[1-(4-hydroxyphenyl)tetrazol-5-yl]sulfanyl-propanamide N-ethyl-2-[1-(4-hydroxyphenyl)te…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.88 -1.64 -11 2 7 0 92 293.352 5 ↓

Analogs

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Popular Name: methyl methyl

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.15 6.55 -10.4 1 9 0 108 393.469 10 ↓

Analogs

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Popular Name: N-methyl-3-[(1-phenyltetrazol-5-yl)amino]propanamide N-methyl-3-[(1-phenyltetrazol-5-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.15 4.43 -18.13 2 7 0 85 246.274 5 ↓

Analogs

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Popular Name: N-ethyl-2-[(1-phenyltetrazol-5-yl)amino]acetamide N-ethyl-2-[(1-phenyltetrazol-5-y…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.75 4.64 -10.59 2 7 0 85 246.274 5 ↓

Analogs

8063783
8063783

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Popular Name: 2-[(1-phenyltetrazol-5-yl)amino]-N-propyl-acetamide 2-[(1-phenyltetrazol-5-yl)amino]…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.26 5.41 -10.54 2 7 0 85 260.301 6 ↓

Analogs

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Popular Name: (2S)-2-amino-2-methyl-3-(1-phenyltetrazol-5-yl)sulfanyl-propanenitrile (2S)-2-amino-2-methyl-3-(1-pheny…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.14 3.67 -12.74 2 6 0 93 260.326 4 ↓
Lo Low (pH 4.5-6) 1.14 3.96 -61.79 3 6 1 95 261.334 4 ↓

Analogs

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Popular Name: (2R)-2-amino-2-methyl-3-(1-phenyltetrazol-5-yl)sulfanyl-propanenitrile (2R)-2-amino-2-methyl-3-(1-pheny…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.14 3.71 -13.3 2 6 0 93 260.326 4 ↓
Lo Low (pH 4.5-6) 1.14 3.99 -60.06 3 6 1 95 261.334 4 ↓

Analogs

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Popular Name: (2S)-2-methyl-2-(methylamino)-3-(1-phenyltetrazol-5-yl)sulfanyl-propanenitrile (2S)-2-methyl-2-(methylamino)-3-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.51 4.21 -13.33 1 6 0 79 274.353 5 ↓
Lo Low (pH 4.5-6) 1.51 5.49 -55.98 2 6 1 84 275.361 5 ↓

Analogs

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Popular Name: (2R)-2-methyl-2-(methylamino)-3-(1-phenyltetrazol-5-yl)sulfanyl-propanenitrile (2R)-2-methyl-2-(methylamino)-3-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.51 4.19 -11.18 1 6 0 79 274.353 5 ↓
Lo Low (pH 4.5-6) 1.51 5.48 -55.51 2 6 1 84 275.361 5 ↓

Analogs

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Popular Name: (2R)-2-(ethylamino)-2-methyl-3-(1-phenyltetrazol-5-yl)sulfanyl-propanenitrile (2R)-2-(ethylamino)-2-methyl-3-(…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.89 5.17 -12.3 1 6 0 79 288.38 6 ↓
Lo Low (pH 4.5-6) 1.89 6.33 -53.19 2 6 1 84 289.388 6 ↓

Analogs

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Popular Name: (2S)-2-(ethylamino)-2-methyl-3-(1-phenyltetrazol-5-yl)sulfanyl-propanenitrile (2S)-2-(ethylamino)-2-methyl-3-(…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.89 5.18 -12.07 1 6 0 79 288.38 6 ↓
Lo Low (pH 4.5-6) 1.89 6.33 -53.64 2 6 1 84 289.388 6 ↓

Analogs

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Popular Name: (2R)-2-methyl-3-(1-phenyltetrazol-5-yl)sulfanyl-2-(propylamino)propanenitrile (2R)-2-methyl-3-(1-phenyltetrazo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.39 5.93 -12.28 1 6 0 79 302.407 7 ↓
Lo Low (pH 4.5-6) 2.39 7.09 -54.13 2 6 1 84 303.415 7 ↓

Analogs

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Popular Name: (2S)-2-methyl-3-(1-phenyltetrazol-5-yl)sulfanyl-2-(propylamino)propanenitrile (2S)-2-methyl-3-(1-phenyltetrazo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.39 5.94 -12.06 1 6 0 79 302.407 7 ↓
Lo Low (pH 4.5-6) 2.39 7.1 -54.55 2 6 1 84 303.415 7 ↓

Analogs

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Popular Name: (2R)-2-(isopropylamino)-2-methyl-3-(1-phenyltetrazol-5-yl)sulfanyl-propanenitrile (2R)-2-(isopropylamino)-2-methyl…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.19 5.77 -12.23 1 6 0 79 302.407 6 ↓
Lo Low (pH 4.5-6) 2.19 6.65 -52.37 2 6 1 84 303.415 6 ↓

Analogs

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Popular Name: (2S)-2-(isopropylamino)-2-methyl-3-(1-phenyltetrazol-5-yl)sulfanyl-propanenitrile (2S)-2-(isopropylamino)-2-methyl…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.19 5.87 -11.77 1 6 0 79 302.407 6 ↓
Lo Low (pH 4.5-6) 2.19 6.67 -52.49 2 6 1 84 303.415 6 ↓

Analogs

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Popular Name: (2R)-2-amino-2-methyl-4-(1-phenyltetrazol-5-yl)sulfanyl-butanenitrile (2R)-2-amino-2-methyl-4-(1-pheny…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.41 4.46 -12.78 2 6 0 93 274.353 5 ↓
Lo Low (pH 4.5-6) 1.41 4.73 -58.62 3 6 1 95 275.361 5 ↓

Analogs

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Popular Name: (2S)-2-amino-2-methyl-4-(1-phenyltetrazol-5-yl)sulfanyl-butanenitrile (2S)-2-amino-2-methyl-4-(1-pheny…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.41 4.54 -12.18 2 6 0 93 274.353 5 ↓
Lo Low (pH 4.5-6) 1.41 4.77 -58.88 3 6 1 95 275.361 5 ↓

Analogs

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Popular Name: (2R)-2-methyl-2-(methylamino)-4-(1-phenyltetrazol-5-yl)sulfanyl-butanenitrile (2R)-2-methyl-2-(methylamino)-4-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.79 4.77 -15.36 1 6 0 79 288.38 6 ↓
Mid Mid (pH 6-8) 1.79 6.06 -60.46 2 6 1 84 289.388 6 ↓

Analogs

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Popular Name: (2S)-2-methyl-2-(methylamino)-4-(1-phenyltetrazol-5-yl)sulfanyl-butanenitrile (2S)-2-methyl-2-(methylamino)-4-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.79 4.77 -14.27 1 6 0 79 288.38 6 ↓
Mid Mid (pH 6-8) 1.79 6.06 -61.19 2 6 1 84 289.388 6 ↓

Analogs

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Popular Name: (2S)-2-(ethylamino)-2-methyl-4-(1-phenyltetrazol-5-yl)sulfanyl-butanenitrile (2S)-2-(ethylamino)-2-methyl-4-(…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.16 5.68 -15.76 1 6 0 79 302.407 7 ↓
Mid Mid (pH 6-8) 2.16 6.9 -59.07 2 6 1 84 303.415 7 ↓

Analogs

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Popular Name: (2R)-2-(ethylamino)-2-methyl-4-(1-phenyltetrazol-5-yl)sulfanyl-butanenitrile (2R)-2-(ethylamino)-2-methyl-4-(…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.16 5.68 -13.75 1 6 0 79 302.407 7 ↓
Mid Mid (pH 6-8) 2.16 6.91 -58.32 2 6 1 84 303.415 7 ↓

Analogs

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Popular Name: 5-chloro-N-[2-oxo-2-(prop-2-ynylamino)ethyl]-2-(tetrazol-1-yl)benzamide 5-chloro-N-[2-oxo-2-(prop-2-ynyl…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.37 3.34 -18.91 2 8 0 102 318.724 5 ↓

Analogs

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Popular Name: 2-[[2-methyl-5-(tetrazol-1-yl)anilino]methylene]propanedinitrile 2-[[2-methyl-5-(tetrazol-1-yl)an…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.72 6.58 -17.75 1 7 0 103 251.253 3 ↓

Analogs

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Popular Name: 2-hydrazino-4-(tetrazol-1-yl)benzoic 2-hydrazino-4-(tetrazol-1-yl)ben…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.07 1.94 -45.31 3 8 -1 122 219.184 3 ↓

Analogs

19917965
19917965
19917967
19917967

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Popular Name: (2R)-5-methyl-N-[(1S)-1-[3-(tetrazol-1-yl)phenyl]ethyl]hexan-2-amine (2R)-5-methyl-N-[(1S)-1-[3-(tetr…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.15 9.38 -47.64 2 5 1 60 288.419 7 ↓

Analogs

19917965
19917965
19917967
19917967

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Popular Name: (2S)-5-methyl-N-[(1S)-1-[3-(tetrazol-1-yl)phenyl]ethyl]hexan-2-amine (2S)-5-methyl-N-[(1S)-1-[3-(tetr…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.15 9.42 -47.97 2 5 1 60 288.419 7 ↓

Analogs

19917965
19917965
19917967
19917967

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Popular Name: (2R)-5-methyl-N-[(1R)-1-[3-(tetrazol-1-yl)phenyl]ethyl]hexan-2-amine (2R)-5-methyl-N-[(1R)-1-[3-(tetr…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.15 9.41 -47.78 2 5 1 60 288.419 7 ↓

Analogs

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Popular Name: (2S)-5-methyl-N-[(1R)-1-[3-(tetrazol-1-yl)phenyl]ethyl]hexan-2-amine (2S)-5-methyl-N-[(1R)-1-[3-(tetr…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.15 9.39 -47.67 2 5 1 60 288.419 7 ↓

Analogs

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Popular Name: N',N',2-trimethyl-N-[(1R)-1-[3-(tetrazol-1-yl)phenyl]ethyl]propane-1,2-diamine N',N',2-trimethyl-N-[(1R)-1-[3-(…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.74 8.43 -124.29 3 6 2 65 290.415 6 ↓
Hi High (pH 8-9.5) 1.74 4.83 -9.93 1 6 0 59 288.399 6 ↓
Mid Mid (pH 6-8) 1.74 7.5 -41.88 2 6 1 60 289.407 6 ↓

Analogs

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Popular Name: N',N',2-trimethyl-N-[(1S)-1-[3-(tetrazol-1-yl)phenyl]ethyl]propane-1,2-diamine N',N',2-trimethyl-N-[(1S)-1-[3-(…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.74 8.44 -126.96 3 6 2 65 290.415 6 ↓
Hi High (pH 8-9.5) 1.74 4.84 -9.39 1 6 0 59 288.399 6 ↓
Mid Mid (pH 6-8) 1.74 7.68 -42.92 2 6 1 60 289.407 6 ↓

Analogs

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Popular Name: 3-[1-(2,5-dimethylphenyl)tetrazol-5-yl]propanoic 3-[1-(2,5-dimethylphenyl)tetrazo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.64 7.33 -43.63 0 6 -1 84 245.262 4 ↓

Analogs

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Popular Name: 3-[1-(2,3-dimethylphenyl)tetrazol-5-yl]propanoic 3-[1-(2,3-dimethylphenyl)tetrazo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.41 7.24 -43.39 0 6 -1 84 245.262 4 ↓

Analogs

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Popular Name: 3-(1-phenyltetrazol-5-yl)propan-1-amine 3-(1-phenyltetrazol-5-yl)propan-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.05 3.26 -54.51 3 5 1 71 204.257 4 ↓

Analogs

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Popular Name: (2S)-2-methyl-3-(1-phenyltetrazol-5-yl)propan-1-amine (2S)-2-methyl-3-(1-phenyltetrazo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.43 3.68 -56.59 3 5 1 71 218.284 4 ↓

Analogs

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Popular Name: (2R)-2-methyl-3-(1-phenyltetrazol-5-yl)propan-1-amine (2R)-2-methyl-3-(1-phenyltetrazo…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.43 3.68 -60.83 3 5 1 71 218.284 4 ↓

Analogs

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Popular Name: (2S)-4-methyl-2-[(1-phenyltetrazol-5-yl)methyl]pentan-1-amine (2S)-4-methyl-2-[(1-phenyltetraz…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.70 5.46 -50.3 3 5 1 71 260.365 6 ↓

Analogs

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Popular Name: (2R)-4-methyl-2-[(1-phenyltetrazol-5-yl)methyl]pentan-1-amine (2R)-4-methyl-2-[(1-phenyltetraz…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.70 5.44 -60.24 3 5 1 71 260.365 6 ↓

Analogs

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Popular Name: (2S)-2-[(1-phenyltetrazol-5-yl)methyl]pentan-1-amine (2S)-2-[(1-phenyltetrazol-5-yl)m…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.49 4.92 -49.6 3 5 1 71 246.338 6 ↓

Analogs

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Popular Name: (2R)-2-[(1-phenyltetrazol-5-yl)methyl]pentan-1-amine (2R)-2-[(1-phenyltetrazol-5-yl)m…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.49 4.94 -58.9 3 5 1 71 246.338 6 ↓

Analogs

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Popular Name: (2R)-3-methyl-2-[(1-phenyltetrazol-5-yl)methyl]butan-1-amine (2R)-3-methyl-2-[(1-phenyltetraz…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.93 4.52 -48.67 3 5 1 71 246.338 5 ↓

Analogs

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Popular Name: (2S)-3-methyl-2-[(1-phenyltetrazol-5-yl)methyl]butan-1-amine (2S)-3-methyl-2-[(1-phenyltetraz…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.93 4.58 -52.44 3 5 1 71 246.338 5 ↓

Analogs

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Popular Name: (2S)-2-[(1-phenyltetrazol-5-yl)methyl]butan-1-amine (2S)-2-[(1-phenyltetrazol-5-yl)m…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.93 4.15 -49.03 3 5 1 71 232.311 5 ↓

Analogs

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Popular Name: (2R)-2-[(1-phenyltetrazol-5-yl)methyl]butan-1-amine (2R)-2-[(1-phenyltetrazol-5-yl)m…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.93 4.19 -58.07 3 5 1 71 232.311 5 ↓

Analogs

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Popular Name: N-methyl-3-(1-phenyltetrazol-5-yl)propan-1-amine N-methyl-3-(1-phenyltetrazol-5-y…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.93 5.14 -49.97 2 5 1 60 218.284 5 ↓

Analogs

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Popular Name: N-ethyl-3-(1-phenyltetrazol-5-yl)propan-1-amine N-ethyl-3-(1-phenyltetrazol-5-yl…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.96 5.99 -49.54 2 5 1 60 232.311 6 ↓

Analogs

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Popular Name: 2-methyl-N-[3-(1-phenyltetrazol-5-yl)propyl]propan-2-amine 2-methyl-N-[3-(1-phenyltetrazol-…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.12 6.94 -46.92 2 5 1 60 260.365 6 ↓

Analogs

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Popular Name: (2S)-N,2-dimethyl-3-(1-phenyltetrazol-5-yl)propan-1-amine (2S)-N,2-dimethyl-3-(1-phenyltet…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.41 5.55 -51.27 2 5 1 60 232.311 5 ↓

Analogs

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Popular Name: (2R)-N,2-dimethyl-3-(1-phenyltetrazol-5-yl)propan-1-amine (2R)-N,2-dimethyl-3-(1-phenyltet…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.41 5.55 -55.28 2 5 1 60 232.311 5 ↓

Analogs

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Popular Name: (2S)-N-ethyl-2-methyl-3-(1-phenyltetrazol-5-yl)propan-1-amine (2S)-N-ethyl-2-methyl-3-(1-pheny…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.43 6.4 -50.81 2 5 1 60 246.338 6 ↓

Parameters Provided:

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filter.purchasability = annotated
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Structural Results Found: (before additional filtering)

SQL Query Was

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